Geometry & MOs

Info

ID:

45180

PubChem CID:

10508833

Reduced:

N7O9C33H51 (1)

Stoich.:

A7B9C33D51 (1)

Weight, g/mol:

689.308141

ΔHf, kcal/mol:

-417.12

Dipole, Da:

2.09

IP(EA), eV:

 -9.13(-0.26)

Spin(Sz, S2):

 None, None

Charge, e:

 0

Chem-info

IUPAC name:

1-[(2R,4S,5R)-5-[[tert-butyl(dimethyl)silyl]oxymethyl]-4-[[(3S)-3-[[tert-butyl(dimethyl)silyl]oxymethyl]-3,4-dihydro-[1,3,2]oxazaphosphinino[3,4-a]indol-1-yl]oxy]oxolan-2-yl]-5-methylpyrimidine-2,4-dione

Drug info:

PubChemData

Smile

CCCC[C@@H](C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](C(C)C)C(=O)C[C@H](CC1=CC=CC=C1)C(=O)O)NC(=O)[C@H](CCCN=C(N)N)NC(=O)C

DOS

IR

Vibrations